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(3S)-1-cyclopentyl-3-[4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]piperidin-1-ium
(3S)-1-cyclopentyl-3-[4-[3-(trifluoromethyl)phenyl]-1H-pyrazol-5-yl]piperidin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
C1CCC(C1)[NH+]2CCCC(C2)C3=C(C=NN3)C4=CC(=CC=C4)C(F)(F)F
Isomeric SMILES
C1CCC(C1)[NH+]2CCC[C@@H](C2)C3=C(C=NN3)C4=CC(=CC=C4)C(F)(F)F
InChI
InChI=1S/C20H24F3N3/c21-20(22,23)16-7-3-5-14(11-16)18-12-24-25-19(18)15-6-4-10-26(13-15)17-8-1-2-9-17/h3,5,7,11-12,15,17H,1-2,4,6,8-10,13H2,(H,24,25)/p+1/t15-/m0/s1
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